6-[4-(phenylmethyl)piperidin-1-yl]-N4-pyridin-4-yl-pyrimidine-4,5-diamine

Systemtic Name: 6-[4-(phenylmethyl)piperidin-1-yl]-N4-pyridin-4-yl-pyrimidine-4,5-diamine Openeye Name: 6-(4-benzyl-1-piperidyl)-N4-(4-pyridyl)pyrimidine-4,5-diamine CAS Name: 6-[4-(phenylmethyl)-1-piperidinyl]-N4-pyridin-4-ylpyrimidine-4,5-diamine IUPAC Name: 6-(4-benzylpiperidin-1-yl)-4-N-pyridin-4-ylpyrimidine-4,5-diamine Traditional Name: [5-amino-6-(4-benzylpiperidino)pyrimidin-4-yl]-(4-pyridyl)amine Formula: C21H24N6 MolecularWeight: 360.45546

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)C3=C(C(=NC=N3)NC4=CC=NC=C4)N

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)C3=C(C(=NC=N3)NC4=CC=NC=C4)N

InChI

InChI=1S/C21H24N6/c22-19-20(26-18-6-10-23-11-7-18)24-15-25-21(19)27-12-8-17(9-13-27)14-16-4-2-1-3-5-16/h1-7,10-11,15,17H,8-9,12-14,22H2,(H,23,24,25,26)